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1,3-Benzodithiole, 2-(3-phenylpropylidene)-
SpectraBase Compound ID LAOBoHfSlhC
InChI InChI=1S/C16H14S2/c1-2-7-13(8-3-1)9-6-12-16-17-14-10-4-5-11-15(14)18-16/h1-5,7-8,10-12H,6,9H2
InChIKey KCACYCWZIRWLRA-UHFFFAOYSA-N
Mol Weight 270.41 g/mol
Molecular Formula C16H14S2
Exact Mass 270.053693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9O2GORKnGSB
Name 1,3-Benzodithiole, 2-(3-phenylpropylidene)-
Alternate Name(s) 2-(3-phenylpropylidene)-1,3-benzodithiole [4,4-{1,2-benzenediyldithio}but-3-enyl]benzene
CAS Registry Number 87543-10-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14S2
InChI InChI=1S/C16H14S2/c1-2-7-13(8-3-1)9-6-12-16-17-14-10-4-5-11-15(14)18-16/h1-5,7-8,10-12H,6,9H2
InChIKey KCACYCWZIRWLRA-UHFFFAOYSA-N
Molecular Weight 270.408 g/mol
SMILES C1(Sc2ccccc2S1)=CCCc1ccccc1
SPLASH splash10-004i-3910000000-0a2fa1259fd96da7cb56
Source of Spectrum J-55-5082-6
Wiley ID 1274392